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canSAR1690713
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NAMES
    SMILES
    Cn1c(-c2ccccc2)cnc1NCc1cccc([N+](=O)[O-])c1
    InChI
    InChI=1S/C17H16N4O2/c1-20-16(14-7-3-2-4-8-14)12-19-17(20)18-11-13-6-5-9-15(10-13)21(22)23/h2-10,12H,11H2,1H3,(H,18,19)
    MOLECULAR FORMULA
    C17H16N4O2
    CROSS REFERENCES
    1690713 logo

    canSAR1690713

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 308.13
    AlogP 3.61
    HBond donors 1
    HBond acceptors 6
    Atoms 39
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1690713.